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5-seco-Butylindole
SpectraBase Compound ID JlCAueRQQed
InChI InChI=1S/C12H15N/c1-3-9(2)10-4-5-12-11(8-10)6-7-13-12/h4-9,13H,3H2,1-2H3
InChIKey YXFJPPJKFXDSFJ-UHFFFAOYSA-N
Mol Weight 173.26 g/mol
Molecular Formula C12H15N
Exact Mass 173.120449 g/mol

Mass Spectrum (GC)

Mass Spectrum (GC)

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SpectraBase Spectrum ID 5RSdd2x5w8x
Name 5-seco-Butylindole
Alternate Name(s) 5-butan-2-yl-1H-indole
Comments Less than 3 mono-isotopic peaks
Copyright Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved.
Formula C12H15N
InChI InChI=1S/C12H15N/c1-3-9(2)10-4-5-12-11(8-10)6-7-13-12/h4-9,13H,3H2,1-2H3
InChIKey YXFJPPJKFXDSFJ-UHFFFAOYSA-N
Molecular Weight 173.259 g/mol
SMILES [nH]1ccc2c1ccc(c2)C(CC)C
SPLASH splash10-0006-0900000000-0c51524e0539a8f9386b
Source of Spectrum KC-57-3326-3
Wiley ID 1623727